N,4-dimethyl-3-[[(E)-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoyl]amino]benzamide

Systemtic Name: N,4-dimethyl-3-[[(E)-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoyl]amino]benzamide Openeye Name: 3-[[(E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)prop-2-enoyl]amino]-N,4-dimethyl-benzamide CAS Name: N,4-dimethyl-3-[[(E)-1-oxo-3-[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]prop-2-enyl]amino]benzamide IUPAC Name: 3-[[(E)-3-(1-benzyl-3-phenylpyrazol-4-yl)prop-2-enoyl]amino]-N,4-dimethylbenzamide Traditional Name: 3-[[(E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)acryloyl]amino]-N,4-dimethyl-benzamide Formula: C28H26N4O2 MolecularWeight: 450.53164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC)NC(=O)C=CC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC)NC(=O)/C=C/C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C28H26N4O2/c1-20-13-14-23(28(34)29-2)17-25(20)30-26(33)16-15-24-19-32(18-21-9-5-3-6-10-21)31-27(24)22-11-7-4-8-12-22/h3-17,19H,18H2,1-2H3,(H,29,34)(H,30,33)/b16-15+